COMGENEX-ZINC06870590 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0300 1.5320 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 0.0030 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4370 -0.3360 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.5010 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.9780 2.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -0.4230 1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -1.0000 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -1.8840 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -1.1340 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9290 -0.7030 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 0.2370 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.5160 0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -1.3580 -0.9270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7440 -0.9400 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7480 -1.2940 -0.5580 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.8260 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -0.2460 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 0.4320 2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -2.7700 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -3.6050 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -4.8550 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -5.0340 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -3.5660 0.6540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.9170 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.9000 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8700 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.2000 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -1.6010 2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 -2.2110 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -2.7550 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -0.1790 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -1.5690 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.4550 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.1640 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -0.0780 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -1.7040 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -3.3270 -2.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -5.6260 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -5.9420 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END